N-(3-acetamido-4-fluoranyl-phenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide

Systemtic Name: N-(3-acetamido-4-fluoranyl-phenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Openeye Name: N-(3-acetamido-4-fluoro-phenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide CAS Name: N-(3-acetamido-4-fluorophenyl)-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide IUPAC Name: N-(3-acetamido-4-fluorophenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Traditional Name: N-(3-acetamido-4-fluoro-phenyl)-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carboxamide Formula: C20H18FN3O2S2 MolecularWeight: 415.504223

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(SC3=C2CCSC3)N4C=CC=C4)F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(SC3=C2CCSC3)N4C=CC=C4)F

InChI

InChI=1S/C20H18FN3O2S2/c1-12(25)22-16-10-13(4-5-15(16)21)23-19(26)18-14-6-9-27-11-17(14)28-20(18)24-7-2-3-8-24/h2-5,7-8,10H,6,9,11H2,1H3,(H,22,25)(H,23,26)